1-[4-Methoxy-2-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-Phenyl]Ethanone
[CAS# 20309-70-0]

Identification

• Name: 1-[4-Methoxy-2-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-Phenyl]Ethanone
• Synonyms: 1-[4-Methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Phenyl]Ethanone; 1-[4-Methoxy-2-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Phenyl]Ethanone; 1-[4-Methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Phenyl]Ethanone
• Molecular Formula: C₁₅H₂₀O₈
• Molecular Weight: 328.32
• CAS Registry Number: 20309-70-0
• SMILES: [C@@H]1([C@@H]([C@@H](O)[C@@H]([C@H](O1)CO)O)O)OC2=C(C=CC(=C2)OC)C(=O)C
• InChI: 1S/C15H20O8/c1-7(17)9-4-3-8(21-2)5-10(9)22-15-14(20)13(19)12(18)11(6-16)23-15/h3-5,11-16,18-20H,6H2,1-2H3/t11-,12-,13+,14-,15-/m1/s1
• InChIKey: AVIUTYMRHHBXPB-UXXRCYHCSA-N

Properties

• Density: 1.415g/cm³ (Cal.)
• Boiling point: 589.946°C at 760 mmHg (Cal.)
• Flash point: 219.193°C (Cal.)